General Information of the Compound
Compound ID
CP0396367
Compound Name
N-(9H-fluoren-2-ylmethyl)-4-phenylbenzamide
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Structure
Formula
C27H21NO
Molecular Weight
375.471
Canonical SMILES
O=C(NCc1ccc-2c(Cc3ccccc-23)c1)c1ccc(cc1)-c1ccccc1
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InChI
InChI=1S/C27H21NO/c29-27(22-13-11-21(12-14-22)20-6-2-1-3-7-20)28-18-19-10-15-26-24(16-19)17-23-8-4-5-9-25(23)26/h1-16H,17-18H2,(H,28,29)
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InChIKey
JLYUMHPSBGZNRP-UHFFFAOYSA-N
Physicochemical Property
logP
5.8548
Rotatable Bonds
4
Heavy Atom Count
29
Polar Areas
29.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
29

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 134153215
ChEMBL ID
CHEMBL3970733
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04787, Protein-serine O-palmitoleoyltransferase porcupine
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 > 1000 nM
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   LI
   LO
   TS